N-(2-benzylimidazo[1,2-a]pyridin-3-yl)-2-phenylsulfanylacetamide

C22H19N3OS — CID 42694282

IUPACN-(2-benzylimidazo[1,2-a]pyridin-3-yl)-2-phenylsulfanylacetamide
SMILESO=C(CSc1ccccc1)Nc1c(Cc2ccccc2)nc2ccccn12
InChIInChI=1S/C22H19N3OS/c26-21(16-27-18-11-5-2-6-12-18)24-22-19(15-17-9-3-1-4-10-17)23-20-13-7-8-14-25(20)22/h1-14H,15-16H2,(H,24,26)
InChIKeyRTKOETCJLVQXJC-UHFFFAOYSA-N
MW373.48 g/mol
LogP4.66
Rot. Bonds6

About N-(2-benzylimidazo[1,2-a]pyridin-3-yl)-2-phenylsulfanylacetamide

N-(2-benzylimidazo[1,2-a]pyridin-3-yl)-2-phenylsulfanylacetamide (PubChem CID 42694282) has the molecular formula C22H19N3OS and a molecular weight of 373.48 g/mol. Its IUPAC name is N-(2-benzylimidazo[1,2-a]pyridin-3-yl)-2-phenylsulfanylacetamide.

Molecular Properties

Compound NameN-(2-benzylimidazo[1,2-a]pyridin-3-yl)-2-phenylsulfanylacetamide
PubChem CID42694282
Molecular FormulaC22H19N3OS
Molecular Weight373.48 g/mol
Exact Mass373.12
IUPAC NameN-(2-benzylimidazo[1,2-a]pyridin-3-yl)-2-phenylsulfanylacetamide
SMILESO=C(CSc1ccccc1)Nc1c(Cc2ccccc2)nc2ccccn12
InChIInChI=1S/C22H19N3OS/c26-21(16-27-18-11-5-2-6-12-18)24-22-19(15-17-9-3-1-4-10-17)23-20-13-7-8-14-25(20)22/h1-14H,15-16H2,(H,24,26)
InChIKeyRTKOETCJLVQXJC-UHFFFAOYSA-N
XLogP4.66
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.48
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-benzylimidazo[1,2-a]pyridin-3-yl)-2-methoxyacetamide
CID 42694295
N-(2-benzylimidazo[1,2-a]pyridin-3-yl)cyclobutanecarboxamide
CID 42694317
N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]-2-phenylsulfanylacetamide
CID 42693934
N-(2-benzylimidazo[1,2-a]pyridin-3-yl)-4-ethylbenzamide
CID 42694304
2-benzylimidazo[1,2-a]pyridin-3-ol
CID 175985122
N-(2-methoxyimidazo[1,2-a]pyridin-3-yl)-2-phenylacetamide
CID 141310029
2-benzylimidazo[1,2-a]pyridine-3-carbothioamide
CID 82223056
2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide
CID 1261878
2-[(4-methylphenyl)methylsulfanyl]-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide
CID 134050030
N-(2-hydroxyphenyl)-2-phenylsulfanylacetamide
CID 893908
2-(4-acetyl-2-fluorophenyl)sulfanyl-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide
CID 55387670
2-phenylsulfanylacetohydrazide
CID 7037418

Frequently Asked Questions

What is the IUPAC name of N-(2-benzylimidazo[1,2-a]pyridin-3-yl)-2-phenylsulfanylacetamide?
The IUPAC name of N-(2-benzylimidazo[1,2-a]pyridin-3-yl)-2-phenylsulfanylacetamide (CID 42694282) is N-(2-benzylimidazo[1,2-a]pyridin-3-yl)-2-phenylsulfanylacetamide.
What is the SMILES notation for N-(2-benzylimidazo[1,2-a]pyridin-3-yl)-2-phenylsulfanylacetamide?
The canonical SMILES for N-(2-benzylimidazo[1,2-a]pyridin-3-yl)-2-phenylsulfanylacetamide is O=C(CSc1ccccc1)Nc1c(Cc2ccccc2)nc2ccccn12.
What is the InChIKey of N-(2-benzylimidazo[1,2-a]pyridin-3-yl)-2-phenylsulfanylacetamide?
The InChIKey is RTKOETCJLVQXJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3OS/c26-21(16-27-18-11-5-2-6-12-18)24-22-19(15-17-9-3-1-4-10-17)23-20-13-7-8-14-25(20)22/h1-14H,15-16H2,(H,24,26).
What are the key properties of N-(2-benzylimidazo[1,2-a]pyridin-3-yl)-2-phenylsulfanylacetamide?
N-(2-benzylimidazo[1,2-a]pyridin-3-yl)-2-phenylsulfanylacetamide has a molecular weight of 373.48 g/mol, XLogP of 4.66, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-benzylimidazo[1,2-a]pyridin-3-yl)-2-phenylsulfanylacetamide is sourced from PubChem (CID 42694282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).